%chk=000114909.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000114909

0 1
 O  -0.7590000     -0.9259000       1.299700    
 O    1.757600     -0.6296000       2.584000    
 O    1.863100      -3.134200     -3.5100002E-02
 O   -4.648400      0.8719000     -0.8987000    
 O   0.5805000      -2.401200      -2.275300    
 O    4.275700       1.311000      -1.927600    
 O    4.738100       2.428500      0.5731000    
 C    1.111700      -1.921400      3.1800002E-02
 C   0.1972000      -1.993100       1.253100    
 C    2.075600     -0.7616000      0.1572000    
 C    1.048100      -1.872000       2.515900    
 C   0.2456000      -1.888600      -1.212000    
 C   -1.049600      -1.189200      -1.095400    
 C   -1.483400     -0.7358000      0.1537000    
 C    2.342300     -0.2053000       1.418700    
 C   -2.691500     -2.1199999E-02  0.2593000    
 C    2.751000     -0.2408000     -0.9586000    
 C   -3.458200      0.1997000     -0.8902000    
 C   -5.163700       1.417500      0.3324000    
 C   -1.822900     -0.9686000      -2.236800    
 C    3.226600      0.8706000       1.548900    
 C   -3.026900     -0.2769000      -2.130600    
 C   -3.176700      0.4913000       1.535400    
 C    3.640900      0.8264000     -0.8236000    
 C   -4.329800       1.162200       1.562500    
 C    3.875000       1.385100      0.4290000    
 C   -5.295300       2.929500      0.1144000    
 C   -6.554000      0.8011000      0.5276000    
 C    3.625300       2.361200      -2.640200    
 C    6.104900       2.109300      0.8273000    
 H  -0.3451000      -2.948200       1.288700    
 H   0.4017000      -1.904500       3.400200    
 H    1.768100      -2.694200       2.604200    
 H    2.591300     -0.6668000      -1.945900    
 H    2.557100      -3.031900     -0.7088000    
 H   -1.502200      -1.316400      -3.214800    
 H    3.413300       1.304800       2.528500    
 H   -3.623600     -0.1051000      -3.022900    
 H   -2.608900      0.3309000       2.443900    
 H   -4.689500       1.546300       2.514000    
 H   -5.748600       3.431200      0.9765000    
 H   -5.906700       3.144700     -0.7698000    
 H   -4.314700       3.384000     -7.1699999E-02
 H   -7.064100       1.207600       1.407900    
 H   -6.486000     -0.2876000      0.6413000    
 H   -7.187000      0.9795000     -0.3498000    
 H    3.492800       3.238000      -1.998600    
 H    2.655900       2.023400      -3.020200    
 H    4.255600       2.641000      -3.488700    
 H    6.665500       3.044600      0.9091000    
 H    6.523000       1.521600      4.1000000E-03
 H    6.201500       1.559600       1.768900    


%chk=000114909-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000114909

0 1
O -0.821428 -1.253835 1.416058
O 1.726107 -0.776241 2.744757
O 2.026162 -3.326288 0.161142
O -4.645389 0.607597 -0.890638
O 0.780825 -2.705239 -2.165359
O 3.916056 1.481454 -1.944409
O 4.413071 2.629383 0.703486
C 1.171248 -2.129222 0.159535
C 0.259838 -2.277398 1.396844
C 1.995503 -0.847567 0.266197
C 1.067069 -2.092855 2.675259
C 0.308627 -2.139970 -1.125480
C -0.989493 -1.477024 -1.044984
C -1.488139 -1.016458 0.212392
C 2.244315 -0.267735 1.540825
C -2.706310 -0.298303 0.302624
C 2.566883 -0.232699 -0.873985
C -3.428473 -0.056538 -0.902986
C -4.997559 1.490416 0.304197
C -1.770753 -1.250212 -2.216334
C 3.054791 0.881394 1.666612
C -2.980198 -0.552119 -2.157357
C -3.307668 0.113999 1.572211
C 3.362433 0.919702 -0.766029
C -4.412929 0.909720 1.582827
C 3.628748 1.469308 0.525787
C -4.405297 2.887044 0.007845
C -6.533738 1.501102 0.311499
C 3.369969 2.815207 -2.287594
C 5.818532 2.510066 0.244425
H -0.206156 -3.282020 1.379043
H 0.424613 -2.134079 3.568233
H 1.834108 -2.889549 2.713475
H 2.391174 -0.643714 -1.873733
H 2.162469 -3.558084 -0.802621
H -1.377733 -1.622935 -3.167698
H 3.254444 1.306401 2.653576
H -3.584481 -0.362120 -3.047918
H -2.856434 -0.252241 2.498338
H -4.899855 1.200009 2.520737
H -4.658450 3.587174 0.824626
H -4.813785 3.284230 -0.938282
H -3.305416 2.835505 -0.068640
H -6.903935 2.180165 1.100445
H -6.929666 0.489522 0.501252
H -6.916698 1.852333 -0.661665
H 3.545544 3.535899 -1.467838
H 2.285469 2.741141 -2.495674
H 3.905541 3.128108 -3.197008
H 6.258576 3.507699 0.393664
H 5.863358 2.216723 -0.819196
H 6.353706 1.765543 0.863518


